Glycoside
GD006995
Name:
NoneFormula:
C15H14O4N2Cl2SSmiles:
CSc1nc2cc(Cl)c(Cl)cc2n1[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
CSC1=Nc2cc(Cl)c(Cl)cc2[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.46 |
| AlogP: | 1.68 | Num_rotatable_bonds: | 3 |
| MolWt: | 365.24 | Num_heavy_atoms: | 22 |
| TPSA: | 87.74 | NumAromaticRings: | 2 |
Unique Aglycone
AD05726
Formula: C10H5N2Cl2S
Smiles:
CSC1=Nc2cc(Cl)c(Cl)cc2[N]1| HBA: | 2 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.12 |
| AlogP: | 3.59 | Num_rotatable_bonds: | 0 |
| MolWt: | 232.11 | Num_heavy_atoms: | 13 |
| TPSA: | 26.46 | NumAromaticRings: | 1 |
